SCHEMBL8639079

SCHEMBL8639079

O=C(O)c1ccccc1Sc1ccc2cc(Sc3ccccc3C(=O)O)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.57
SIRT1 Q96EB6 1/20 0.53
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
NSD2 O96028 1/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA4 P22748 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
RAB9A P51151 2/20 0.49
PKM P14618 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
CYP1A2 P05177 1/20 0.49
PRKAG1 P54619 1/20 0.47
PRKAA2 P54646 1/20 0.47
PRKAB1 Q9Y478 1/20 0.47
ALOX15 P16050 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5660360 0.96 POLB (0.53) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL231042 0.84 SIRT1 (0.71) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL7008991 0.84 POLB (0.43) POLBSIRT1NSD2CA12CA1
SCHEMBL11472530 0.83 PTPRG (0.58) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL234760 0.83 RHEB (0.52) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL29888792 0.82 POLB (0.74) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL1482567 0.82 POLB (0.74) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL6935437 0.81 SIRT1 (0.58) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL2024004 0.81 ALDH1A1 (0.59) POLBSIRT1KDM4EALDH1A1TDP1
SCHEMBL1447741 0.81 KDM4E (0.59) POLBSIRT1KDM4EALDH1A1TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799267-B1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEM CO (US) 1998-08-05 EP disclosed
EP-0799267-A1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-10-08 EP disclosed
US-5554720-A Naphthalenedicarboxylic acid polymers containing aryl thioethers and having reduced fluorescene EASTMAN CHEMICAL COMPANY (US) 1996-09-10 US disclosed
WO-1996019517-A1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1996-06-27 WO disclosed